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1-(2-Deoxy-5-O-phosphonopentofuranosyl)-4-(hydroxyamino)pyrimidin-2(1H)-one

HCID 159652
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Basic information

CAS
2277-58-9
Standard SMILES
O=c1nc(NO)ccn1[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1
InChIKey
YKOWBJJOJNGCAD-SHYZEUOFSA-N
Molecular formula
C9H14N3O8P
Average molar mass
323.198 g/mol
Monoisotopic mass
323.05185104

Names & identifiers

Preferred name
1-(2-Deoxy-5-O-phosphonopentofuranosyl)-4-(hydroxyamino)pyrimidin-2(1H)-one
IUPAC
2'-Deoxy-N-hydroxycytidine 5'-(dihydrogen phosphate)
English name
N-4-hydroxy-2'-deoxycytidylic acid
Molecular formula
C9H14N3O8P
Molecular weight
323.2

Names & synonyms

N-4-hydroxy-2'-deoxycytidylic acid5'-Uridylic acid, 2'-deoxy-, 4-oxime

Database identifiers

CAS
2277-58-9
PubChem CID
159652
DTXSID
DTXSID00945447
ChEMBL
CHEMBL1161227
Nikkaji
J1.474.608K

Properties

Physicochemical properties

Density
2.04 · 2.04±0.1 g/cm3(Predicted)
pka
1.86 · 1.86±0.10(Predicted)

Related reactions

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